2-(20-isoquinolin-2-ium-2-ylicosyl)isoquinolin-2-ium diiodide

Systemtic Name: 2-(20-isoquinolin-2-ium-2-ylicosyl)isoquinolin-2-ium diiodide Openeye Name: 2-(20-isoquinolin-2-ium-2-ylicosyl)isoquinolin-2-ium diiodide CAS Name: 2-[20-(2-isoquinolin-2-iumyl)eicosyl]isoquinolin-2-ium diiodide IUPAC Name: 2-(20-isoquinolin-2-ium-2-ylicosyl)isoquinolin-2-ium diiodide Traditional Name: 2-(20-isoquinolin-2-ium-2-yleicosyl)isoquinolin-2-ium diiodide Formula: C38H54I2N2 MolecularWeight: 792.6577

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CCCCCCCCCCCCCCCCCCCC[N+]3=CC4=CC=CC=C4C=C3.[I-].[I-]

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CCCCCCCCCCCCCCCCCCCC[N+]3=CC4=CC=CC=C4C=C3.[I-].[I-]

InChI

InChI=1S/C38H54N2.2HI/c1(3-5-7-9-11-13-15-21-29-39-31-27-35-23-17-19-25-37(35)33-39)2-4-6-8-10-12-14-16-22-30-40-32-28-36-24-18-20-26-38(36)34-40;;/h17-20,23-28,31-34H,1-16,21-22,29-30H2;2*1H/q+2;;/p-2